methyl 2-[4-methyl-7-oxidanyl-2-oxidanylidene-8-[[3-(2-oxidanylidenepyrrolidin-1-yl)propylamino]methyl]chromen-3-yl]ethanoate

Systemtic Name: methyl 2-[4-methyl-7-oxidanyl-2-oxidanylidene-8-[[3-(2-oxidanylidenepyrrolidin-1-yl)propylamino]methyl]chromen-3-yl]ethanoate Openeye Name: methyl 2-[7-hydroxy-4-methyl-2-oxo-8-[[3-(2-oxopyrrolidin-1-yl)propylamino]methyl]chromen-3-yl]acetate CAS Name: 2-[7-hydroxy-4-methyl-2-oxo-8-[[3-(2-oxo-1-pyrrolidinyl)propylamino]methyl]-1-benzopyran-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[7-hydroxy-4-methyl-2-oxo-8-[[3-(2-oxopyrrolidin-1-yl)propylamino]methyl]chromen-3-yl]acetate Traditional Name: 2-[7-hydroxy-2-keto-8-[[3-(2-ketopyrrolidino)propylamino]methyl]-4-methyl-chromen-3-yl]acetic acid methyl ester Formula: C21H26N2O6 MolecularWeight: 402.44094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2CNCCCN3CCCC3=O)O)CC(=O)OC

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2CNCCCN3CCCC3=O)O)CC(=O)OC

InChI

InChI=1S/C21H26N2O6/c1-13-14-6-7-17(24)16(12-22-8-4-10-23-9-3-5-18(23)25)20(14)29-21(27)15(13)11-19(26)28-2/h6-7,22,24H,3-5,8-12H2,1-2H3